Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 15/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 15/20 | 0.45 |
| ▸ | GBA1 | P04062 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20212714 | 0.83 | HCRTR1 (0.64) | HCRTR1HCRTR2 | |
| SCHEMBL19893984 | 0.81 | HCRTR1 (0.50) | HCRTR1HCRTR2GBA1KDM4EHSD17B10 | |
| SCHEMBL19894101 | 0.77 | HCRTR1 (0.53) | HCRTR1HCRTR2KDM4EHSD17B10 | |
| SCHEMBL20223570 | 0.75 | HCRTR1 (0.52) | HCRTR1HCRTR2 | |
| SCHEMBL19903012 | 0.74 | HCRTR2 (0.52) | HCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL19893858 | 0.73 | HCRTR2 (0.51) | HCRTR1HCRTR2 | |
| SCHEMBL19894039 | 0.73 | HCRTR1 (0.50) | HCRTR1HCRTR2 | |
| SCHEMBL19893874 | 0.73 | HCRTR2 (0.53) | HCRTR1HCRTR2 | |
| SCHEMBL20212718 | 0.72 | HCRTR1 (0.50) | HCRTR1HCRTR2 | |
| SCHEMBL19894022 | 0.72 | GBA1 (0.45) | HCRTR1HCRTR2GBA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3287454-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2018-02-28 | — | — | EP | disclosed |